N-[2-[4-methyl-5-[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: N-[2-[4-methyl-5-[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[2-[4-methyl-5-[1-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: N-[2-[4-methyl-5-[[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxopropan-2-yl]thio]-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: N-[2-[4-methyl-5-[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxopropan-2-yl]sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[2-[5-[[2-keto-1-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C18H21N7O2S2 MolecularWeight: 431.53504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C(C)SC2=NN=C(N2C)CCNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C(C)SC2=NN=C(N2C)CCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N7O2S2/c1-11(15(26)20-17-23-21-12(2)29-17)28-18-24-22-14(25(18)3)9-10-19-16(27)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,19,27)(H,20,23,26)